COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.027   0.973  -0.974  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.883  -0.381  -0.704  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.891  -1.069  -0.007  1.00  0.00           C  
HETATM    4  N   UNL     1      -0.901  -1.314  -0.973  1.00  0.00           N  
HETATM    5  C   UNL     1      -4.160   0.963   0.130  1.00  0.00           C  
HETATM    6  N   UNL     1      -2.481  -2.358   0.110  1.00  0.00           N  
HETATM    7  C   UNL     1      -5.127  -1.106   1.149  1.00  0.00           C  
HETATM    8  O   UNL     1       1.106  -0.407   0.448  1.00  0.00           O  
HETATM    9  C   UNL     1      -4.034  -0.380   0.407  1.00  0.00           C  
HETATM   10  C   UNL     1       2.779  -0.227  -1.201  1.00  0.00           C  
HETATM   11  C   UNL     1       3.624   0.272  -0.027  1.00  0.00           C  
HETATM   12  C   UNL     1       4.570  -0.363   2.112  1.00  0.00           C  
HETATM   13  C   UNL     1       5.968   0.069   1.663  1.00  0.00           C  
HETATM   14  C   UNL     1       5.842   1.203   0.641  1.00  0.00           C  
HETATM   15  C   UNL     1       4.993   0.724  -0.540  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.158   1.639  -0.553  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.318  -2.501  -0.455  1.00  0.00           C  
HETATM   18  C   UNL     1       0.356  -1.071  -1.684  1.00  0.00           C  
HETATM   19  C   UNL     1       1.390  -0.556  -0.716  1.00  0.00           C  
HETATM   20  N   UNL     1       3.798  -0.814   0.947  1.00  0.00           N  
HETATM   21  O   UNL     1       4.824   1.794  -1.471  1.00  0.00           O  
HETATM   22 CL   UNL     1      -5.584   1.817   0.638  1.00  0.00          Cl  
HETATM   23  H   UNL     1      -1.254   1.504  -1.508  1.00  0.00           H  
HETATM   24  H   UNL     1      -5.845  -1.508   0.434  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.694  -1.922   1.727  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.632  -0.412   1.821  1.00  0.00           H  
HETATM   27  H   UNL     1       2.722   0.550  -1.964  1.00  0.00           H  
HETATM   28  H   UNL     1       3.237  -1.120  -1.625  1.00  0.00           H  
HETATM   29  H   UNL     1       3.120   1.112   0.452  1.00  0.00           H  
HETATM   30  H   UNL     1       4.656  -1.180   2.828  1.00  0.00           H  
HETATM   31  H   UNL     1       4.062   0.479   2.580  1.00  0.00           H  
HETATM   32  H   UNL     1       6.535   0.418   2.525  1.00  0.00           H  
HETATM   33  H   UNL     1       6.481  -0.777   1.206  1.00  0.00           H  
HETATM   34  H   UNL     1       5.363   2.063   1.109  1.00  0.00           H  
HETATM   35  H   UNL     1       6.833   1.486   0.287  1.00  0.00           H  
HETATM   36  H   UNL     1       5.491  -0.112  -1.031  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.270   2.693  -0.764  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.764  -3.427  -0.505  1.00  0.00           H  
HETATM   39  H   UNL     1       0.708  -2.002  -2.130  1.00  0.00           H  
HETATM   40  H   UNL     1       0.193  -0.332  -2.469  1.00  0.00           H  
HETATM   41  H   UNL     1       4.228  -1.619   0.517  1.00  0.00           H  
HETATM   42  H   UNL     1       5.653   2.131  -1.838  1.00  0.00           H  
CONECT    1   16    2    2   23                                       
CONECT    2    1    1    3    4                                       
CONECT    3    9    9    2    6                                       
CONECT    4    2   18   17                                            
CONECT    5   22   16   16    9                                       
CONECT    6    3   17   17                                            
CONECT    7    9   24   25   26                                       
CONECT    8   19   19                                                 
CONECT    9    5    7    3    3                                       
CONECT   10   19   11   27   28                                       
CONECT   11   20   10   15   29                                       
CONECT   12   20   13   30   31                                       
CONECT   13   12   14   32   33                                       
CONECT   14   13   15   34   35                                       
CONECT   15   11   14   21   36                                       
CONECT   16    5    5    1   37                                       
CONECT   17    4    6    6   38                                       
CONECT   18   19    4   39   40                                       
CONECT   19    8    8   10   18                                       
CONECT   20   12   11   41                                            
CONECT   21   15   42                                                 
CONECT   22    5                                                      
CONECT   23    1                                                      
CONECT   24    7                                                      
CONECT   25    7                                                      
CONECT   26    7                                                      
CONECT   27   10                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
